Crystal structure of (5R,8R,9R,10R,12R, 13R,14R,17S)-2-(E-3-fluorobenzylidene)-12-hydroxy-4,4,8,10,14-pentamethyl-17-((R)-2,6,6-trimethyltetrahydro-2H-pyran-2-yl) hexadecahydro-3H-cyclopenta[a]phenanthren-3-one, C37H53FO3

C37H53FO3, orthorhombic, P212121 (no. 19), a = 7.4716(8) Å, b = 15.0009(15) Å, c = 28.065(5) Å, V = 3145.5(7) Å3, Z = 4, Rgt(F) = 0.0643, wRref(F2) = 0.1464, T = 293 K.

Bibliographic Details
Main Authors: Cheng Kuo, Song Ya-Bin, Meng Qing-Guo, Wang Bao-Gang, Hou Yun, Wang Wen-Shui, Jiang Sheng
Format: Article
Language:English
Published: De Gruyter 2024-04-01
Series:Zeitschrift für Kristallographie - New Crystal Structures
Subjects:
Online Access:https://doi.org/10.1515/ncrs-2023-0470
_version_ 1797266177956773888
author Cheng Kuo
Song Ya-Bin
Meng Qing-Guo
Wang Bao-Gang
Hou Yun
Wang Wen-Shui
Jiang Sheng
author_facet Cheng Kuo
Song Ya-Bin
Meng Qing-Guo
Wang Bao-Gang
Hou Yun
Wang Wen-Shui
Jiang Sheng
author_sort Cheng Kuo
collection DOAJ
description C37H53FO3, orthorhombic, P212121 (no. 19), a = 7.4716(8) Å, b = 15.0009(15) Å, c = 28.065(5) Å, V = 3145.5(7) Å3, Z = 4, Rgt(F) = 0.0643, wRref(F2) = 0.1464, T = 293 K.
first_indexed 2024-04-25T00:56:33Z
format Article
id doaj.art-d371568e74f84e1f8b73dfc132cb3233
institution Directory Open Access Journal
issn 1433-7266
2197-4578
language English
last_indexed 2024-04-25T00:56:33Z
publishDate 2024-04-01
publisher De Gruyter
record_format Article
series Zeitschrift für Kristallographie - New Crystal Structures
spelling doaj.art-d371568e74f84e1f8b73dfc132cb32332024-03-11T10:04:44ZengDe GruyterZeitschrift für Kristallographie - New Crystal Structures1433-72662197-45782024-04-01239217918210.1515/ncrs-2023-0470Crystal structure of (5R,8R,9R,10R,12R, 13R,14R,17S)-2-(E-3-fluorobenzylidene)-12-hydroxy-4,4,8,10,14-pentamethyl-17-((R)-2,6,6-trimethyltetrahydro-2H-pyran-2-yl) hexadecahydro-3H-cyclopenta[a]phenanthren-3-one, C37H53FO3Cheng Kuo0Song Ya-Bin1Meng Qing-Guo2Wang Bao-Gang3Hou Yun4Wang Wen-Shui5Jiang Sheng6School of Pharmacy, Collaborative Innovation Center of Advanced Drug Delivery System and Biotech Drugs in Universities of Shandong, Key Laboratory of Molecular Pharmacology and Drug Evaluation (Yantai University), Ministry of Education, Yantai University, Yantai, P.R. ChinaState Key Laboratory of Pathogen and Biosecurity, Beijing Institute of Microbiology and Epidemiology, 100071Beijing, P.R. ChinaSchool of Pharmacy, Collaborative Innovation Center of Advanced Drug Delivery System and Biotech Drugs in Universities of Shandong, Key Laboratory of Molecular Pharmacology and Drug Evaluation (Yantai University), Ministry of Education, Yantai University, Yantai, P.R. ChinaState Key Laboratory of Pathogen and Biosecurity, Beijing Institute of Microbiology and Epidemiology, 100071Beijing, P.R. ChinaSchool of Pharmacy, Department of Histology and Embryology, Basic Medical College, Binzhou Medical University, Yantai, 264003, P.R. ChinaShandong Shenxiangchuanqi Biotechnology Co., Ltd., Weihai, Shandong, 264400, ChinaShandong Shenxiangchuanqi Biotechnology Co., Ltd., Weihai, Shandong, 264400, ChinaC37H53FO3, orthorhombic, P212121 (no. 19), a = 7.4716(8) Å, b = 15.0009(15) Å, c = 28.065(5) Å, V = 3145.5(7) Å3, Z = 4, Rgt(F) = 0.0643, wRref(F2) = 0.1464, T = 293 K.https://doi.org/10.1515/ncrs-2023-04702283345
spellingShingle Cheng Kuo
Song Ya-Bin
Meng Qing-Guo
Wang Bao-Gang
Hou Yun
Wang Wen-Shui
Jiang Sheng
Crystal structure of (5R,8R,9R,10R,12R, 13R,14R,17S)-2-(E-3-fluorobenzylidene)-12-hydroxy-4,4,8,10,14-pentamethyl-17-((R)-2,6,6-trimethyltetrahydro-2H-pyran-2-yl) hexadecahydro-3H-cyclopenta[a]phenanthren-3-one, C37H53FO3
Zeitschrift für Kristallographie - New Crystal Structures
2283345
title Crystal structure of (5R,8R,9R,10R,12R, 13R,14R,17S)-2-(E-3-fluorobenzylidene)-12-hydroxy-4,4,8,10,14-pentamethyl-17-((R)-2,6,6-trimethyltetrahydro-2H-pyran-2-yl) hexadecahydro-3H-cyclopenta[a]phenanthren-3-one, C37H53FO3
title_full Crystal structure of (5R,8R,9R,10R,12R, 13R,14R,17S)-2-(E-3-fluorobenzylidene)-12-hydroxy-4,4,8,10,14-pentamethyl-17-((R)-2,6,6-trimethyltetrahydro-2H-pyran-2-yl) hexadecahydro-3H-cyclopenta[a]phenanthren-3-one, C37H53FO3
title_fullStr Crystal structure of (5R,8R,9R,10R,12R, 13R,14R,17S)-2-(E-3-fluorobenzylidene)-12-hydroxy-4,4,8,10,14-pentamethyl-17-((R)-2,6,6-trimethyltetrahydro-2H-pyran-2-yl) hexadecahydro-3H-cyclopenta[a]phenanthren-3-one, C37H53FO3
title_full_unstemmed Crystal structure of (5R,8R,9R,10R,12R, 13R,14R,17S)-2-(E-3-fluorobenzylidene)-12-hydroxy-4,4,8,10,14-pentamethyl-17-((R)-2,6,6-trimethyltetrahydro-2H-pyran-2-yl) hexadecahydro-3H-cyclopenta[a]phenanthren-3-one, C37H53FO3
title_short Crystal structure of (5R,8R,9R,10R,12R, 13R,14R,17S)-2-(E-3-fluorobenzylidene)-12-hydroxy-4,4,8,10,14-pentamethyl-17-((R)-2,6,6-trimethyltetrahydro-2H-pyran-2-yl) hexadecahydro-3H-cyclopenta[a]phenanthren-3-one, C37H53FO3
title_sort crystal structure of 5r 8r 9r 10r 12r 13r 14r 17s 2 e 3 fluorobenzylidene 12 hydroxy 4 4 8 10 14 pentamethyl 17 r 2 6 6 trimethyltetrahydro 2h pyran 2 yl hexadecahydro 3h cyclopenta a phenanthren 3 one c37h53fo3
topic 2283345
url https://doi.org/10.1515/ncrs-2023-0470
work_keys_str_mv AT chengkuo crystalstructureof5r8r9r10r12r13r14r17s2e3fluorobenzylidene12hydroxy4481014pentamethyl17r266trimethyltetrahydro2hpyran2ylhexadecahydro3hcyclopentaaphenanthren3onec37h53fo3
AT songyabin crystalstructureof5r8r9r10r12r13r14r17s2e3fluorobenzylidene12hydroxy4481014pentamethyl17r266trimethyltetrahydro2hpyran2ylhexadecahydro3hcyclopentaaphenanthren3onec37h53fo3
AT mengqingguo crystalstructureof5r8r9r10r12r13r14r17s2e3fluorobenzylidene12hydroxy4481014pentamethyl17r266trimethyltetrahydro2hpyran2ylhexadecahydro3hcyclopentaaphenanthren3onec37h53fo3
AT wangbaogang crystalstructureof5r8r9r10r12r13r14r17s2e3fluorobenzylidene12hydroxy4481014pentamethyl17r266trimethyltetrahydro2hpyran2ylhexadecahydro3hcyclopentaaphenanthren3onec37h53fo3
AT houyun crystalstructureof5r8r9r10r12r13r14r17s2e3fluorobenzylidene12hydroxy4481014pentamethyl17r266trimethyltetrahydro2hpyran2ylhexadecahydro3hcyclopentaaphenanthren3onec37h53fo3
AT wangwenshui crystalstructureof5r8r9r10r12r13r14r17s2e3fluorobenzylidene12hydroxy4481014pentamethyl17r266trimethyltetrahydro2hpyran2ylhexadecahydro3hcyclopentaaphenanthren3onec37h53fo3
AT jiangsheng crystalstructureof5r8r9r10r12r13r14r17s2e3fluorobenzylidene12hydroxy4481014pentamethyl17r266trimethyltetrahydro2hpyran2ylhexadecahydro3hcyclopentaaphenanthren3onec37h53fo3